2-[methyl-(4-methylcyclohexyl)amino]-3-nitro-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one

Systemtic Name: 2-[methyl-(4-methylcyclohexyl)amino]-3-nitro-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one Openeye Name: 2-[methyl-(4-methylcyclohexyl)amino]-3-nitro-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one CAS Name: 2-[methyl-(4-methylcyclohexyl)amino]-3-nitro-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one IUPAC Name: 2-[methyl-(4-methylcyclohexyl)amino]-3-nitro-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one Traditional Name: 2-[methyl-(4-methylcyclohexyl)amino]-3-nitro-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one Formula: C16H21N4O3+ MolecularWeight: 317.36294

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(CC1)N(C)C2=C(C(=O)[N+]3=CC=CC=C3N2)[N+](=O)[O-]

Isomeric SMILES

CC1CCC(CC1)N(C)C2=C(C(=O)[N+]3=CC=CC=C3N2)[N+](=O)[O-]

InChI

InChI=1S/C16H20N4O3/c1-11-6-8-12(9-7-11)18(2)15-14(20(22)23)16(21)19-10-4-3-5-13(19)17-15/h3-5,10-12H,6-9H2,1-2H3/p+1